(2-phenylazanyl-1,3-thiazol-4-yl)methyl 4-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 4-morpholin-4-ylsulfonylbenzoate Openeye Name: (2-anilinothiazol-4-yl)methyl 4-morpholinosulfonylbenzoate CAS Name: 4-(4-morpholinylsulfonyl)benzoic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 4-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-morpholinosulfonylbenzoic acid (2-anilinothiazol-4-yl)methyl ester Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)NC4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)NC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O5S2/c25-20(29-14-18-15-30-21(23-18)22-17-4-2-1-3-5-17)16-6-8-19(9-7-16)31(26,27)24-10-12-28-13-11-24/h1-9,15H,10-14H2,(H,22,23)